SCHEMBL519066

SCHEMBL519066

O=C(O)Nc1ccccn1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.73
NPC1 O15118 9/20 0.73
PKM P14618 3/20 0.73
GAA P10253 1/20 0.68
SMN1; SMN2 Q16637 3/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
ADORA3 P0DMS8 1/20 0.67
PIM1 P11309 1/20 0.67
ADORA2A P29274 1/20 0.67
ADORA2B P29275 1/20 0.67
ADORA1 P30542 1/20 0.67
FLT3 P36888 1/20 0.67
PIM3 Q86V86 1/20 0.67
AURKB Q96GD4 1/20 0.67
KDM4E B2RXH2 3/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
CYP1A2 P05177 1/20 0.62
HSD17B10 Q99714 1/20 0.62
ALDH1A1 P00352 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Pyrrole SCHEMBL28092032 0.89 GAA (0.61) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL30565139 0.84 RAB9A (1.00) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL9750118 0.84 NPC1 (0.81) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL7165468 0.83 RAB9A (0.81) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL3078691 0.83 RAB9A (0.73) RAB9ANPC1PKMGAASMN1; SMN2
Hydrochloric Acid SCHEMBL7128897 0.82 RAB9A (0.78) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL997866 0.82 RAB9A (0.89) RAB9ANPC1PKMGAASMN1; SMN2
Bicarbonate SCHEMBL4653075 0.82 RAB9A (0.66) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL29366822 0.82 RAB9A (0.89) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL6879467 0.81 RAB9A (0.70) RAB9ANPC1PKMGAASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 300 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651893-B1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2016-03-30 EP claimed
EP-1776342-B1 PROCESS FOR PREPARING CARBOXAMIDE PYRIDINE DERIVATIVES USED AS INTERMEDIATES IN THE SYNTHESIS OF NK-1 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2011-03-02 EP claimed
EP-1948609-B1 PROCESS FOR THE PREPARATION OF PYRIDYLCARBOXYLIC AMIDES AND ESTERS BASF SE (DE) 2010-03-10 EP claimed
EP-0799209-B1 SULFONAMIDES HOFFMANN LA ROCHE (CH) 2003-08-06 EP claimed
EP-1309590-A1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2003-05-14 EP claimed
WO-2001098299-A1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2001-12-27 WO claimed
US-5977146-A Pyridylcarbamates, process and intermediates for their preparation, and their use BASF AKTIENGESELLSCHAFT (DE) 1999-11-02 US claimed
WO-1999012532-A2 PIPERIDINE DERIVATIVES AGAINST MALARIA F.HOFFMANN-LA ROCHE AG (CH) 1999-03-18 WO claimed
EP-0874825-A1 PYRIDYL CARBAMATES, PROCESS AND INTERMEDIATES FOR THE PREPARATION AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1998-11-04 EP claimed
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP claimed
WO-1997021679-A1 PYRIDYL CARBAMATES, PROCESS AND INTERMEDIATES FOR THE PREPARATION AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1997-06-19 WO claimed
EP-0430127-A2 Pyridylcarbamate compounds, process for preparing the same, and biocidal composition containing the same for controlling harmful organisms ISHIHARA SANGYO KAISHA, Ltd. (JP) 1991-06-05 EP claimed
EP-0194562-B1 FUNGICIDAL COMPOSITION TOSOH CORPORATION (JP) 1990-10-03 EP claimed
US-4826859-A Fungicidal methods containing N-pyridylcarbamates TOSOH CORPORATION (JP) 1989-05-02 US claimed
EP-0194562-A1 Fungicidal composition TOSOH CORPORATION (JP) 1986-09-17 EP claimed
EP-0033231-A1 Insecticidal compositions containing 2,6-dihalobenzoylurea derivatives ELI LILLY AND COMPANY (US) 1981-08-05 EP claimed
JP-61176566-A None JP disclosed
JP-61180703-A None JP disclosed
JP-S5536430-A PYRIDYL CARBAMATE COMPOUND AND NON-MEDICAL MICROBICIDE CONTAINING THE SAME ISHIHARA SANGYO KAISHA LTD 1980-03-14 JP disclosed
US-3969362-A FUNGICIDE ISHIHARA SANGYO KAISHA LTD. (JA) 1976-07-13 US disclosed